[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine

C12H19N3O — CID 62288053

IUPAC[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine
SMILESCN1CCC(Oc2ccnc(CN)c2)CC1
InChIInChI=1S/C12H19N3O/c1-15-6-3-11(4-7-15)16-12-2-5-14-10(8-12)9-13/h2,5,8,11H,3-4,6-7,9,13H2,1H3
InChIKeySCMLNGUERSXTLS-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.01
Rot. Bonds3

About [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine

[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine (PubChem CID 62288053) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine
PubChem CID62288053
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine
SMILESCN1CCC(Oc2ccnc(CN)c2)CC1
InChIInChI=1S/C12H19N3O/c1-15-6-3-11(4-7-15)16-12-2-5-14-10(8-12)9-13/h2,5,8,11H,3-4,6-7,9,13H2,1H3
InChIKeySCMLNGUERSXTLS-UHFFFAOYSA-N
XLogP1.01
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methyl]cyclopropanamine
CID 62288585
2-methyl-4-(1-methylpiperidin-4-yl)oxypyridine
CID 70213870
[2-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methanamine;hydrochloride
CID 159598247
4-(1-methylpiperidin-4-yl)oxypyridine
CID 18723159
[3-(1-methylpiperidin-4-yl)oxyphenyl]methanamine;hydrochloride
CID 68965595
N-[[2-(aminomethyl)-4-pyridinyl]methyl]-N,1-dimethylpiperidin-4-amine
CID 63886661
3-(1-methylpiperidin-4-yl)oxyaniline;dihydrochloride
CID 117045727
(4-cyclopentyloxy-2-pyridinyl)methanol
CID 61258192
[4-(cyclopropylmethoxy)-2-pyridinyl]methanamine
CID 62291672
5-(1-methylpiperidin-4-yl)oxypyridin-2-amine
CID 71565292
3-(1-methylpiperidin-4-yl)oxypyridine
CID 18433351
1-[5-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]propan-1-amine
CID 112584872

Frequently Asked Questions

What is the IUPAC name of [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine?
The IUPAC name of [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine (CID 62288053) is [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine.
What is the SMILES notation for [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine?
The canonical SMILES for [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine is CN1CCC(Oc2ccnc(CN)c2)CC1.
What is the InChIKey of [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine?
The InChIKey is SCMLNGUERSXTLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-15-6-3-11(4-7-15)16-12-2-5-14-10(8-12)9-13/h2,5,8,11H,3-4,6-7,9,13H2,1H3.
What are the key properties of [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine?
[4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine has a molecular weight of 221.30 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]methanamine is sourced from PubChem (CID 62288053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).